Geometry & MOs

Info

ID:	260654
PubChem CID:	103199103
Reduced:	F2N2O5C12H12 (1)
Stoich.:	A2B2C5D12E12 (1)
Weight, g/mol:	311.0639
ΔH_f, kcal/mol:	-199.63
Dipole, Da:	5.85
IP(EA), eV:	-10.38(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-(difluoromethyl)-2-(2-methylsulfonylpropan-2-yl)-1,3-oxazole-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N=C(O1)C2=NOC(=C2)COC)C(F)F

DOS

IR

Vibrations